Azobenzene, 4-bis(2-chloropropyl)amino-2'-carboxy-2-methyl-
Basic information
- CAS
40136-92-3- Standard SMILES
Cc1cc(N(CCCCl)CCCCl)ccc1N=Nc1ccccc1C(=O)O- InChIKey
JHXSLWUFMYYBJP-UHFFFAOYSA-N- Molecular formula
- C20H23Cl2N3O2
- Average molar mass
- 408.3 g/mol
- Monoisotopic mass
- 407.1167324
Names & identifiers
- Preferred name
- Azobenzene, 4-bis(2-chloropropyl)amino-2'-carboxy-2-methyl-
- IUPAC
- 2-[[4-[bis(3-chloropropyl)amino]-2-methylphenyl]diazenyl]benzoic acid
Names & synonyms
NSC 240415Azobenzene, 4-bis(2-chloropropyl)amino-2'-carboxy-2-methyl-Benzoic acid, 2-(4-(bis(2-chloropropyl)amino)-1-(o-tolyl))azo-BENZOIC ACID, 2-(4-BIS(2-CHLOROPROPYL)AMINO-2-METHYL)PHENYLAZO-
Database identifiers
- CAS
40136-92-3- PubChem CID
- 38400
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 65.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 470
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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